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Title: Spatial dependence of the growth of polycyclic aromatic compounds in an ethylene counterflow flame: experimental measurements and simulation results Open Access Deposited

http://creativecommons.org/licenses/by-nc/4.0/
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Methodology
  • Details have been discussed in the article in CARBON: Spatial dependence of the growth of polycyclic aromatic compounds in an ethylene counterflow flame.
Description
  • Datasets for article in CARBON: Spatial dependence of the growth of polycyclic aromatic compounds in an ethylene counterflow flame. The experiment VUV-AMS measurements ("VUV_AMS_C2H4_Counterflow.txt") consists aerosol mass spectra data from an atmospheric-pressure ethylene/oxygen/argon counterflow diffusion flame described in Johansson et al., Proc. Combust. Inst. 36, 799-806 (2017) doi:10.1016/j.proci.2016.07.130.

  • The experiment VUV-MBMS measurements ("VUV_MBMS_C2H4_Counterflow.txt") consists gas-phase data from an atmospheric-pressure ethylene/oxygen/argon counterflow diffusion flame described in Johansson et al., Proc. Combust. Inst. 36, 799-806 (2017) doi:10.1016/j.proci.2016.07.130.

  • 2D CFD simulation results by KAUST mechanism II ("CFD_KM2_results.xlsx") consists stabilized CFD gas-phase species profiles along different x,y,z coordinates. Species are given by mole fractions.

  • The SNapS2 simulation results ("SNapS2_results.zip") consist streamline I (from fuel side), i (from oxidizer side), and middle (DFFO = 5.0mm) for producing results in Fig. 5, Fig. 6, and Table 1. Three folders under each streamline ("C5H6", "C6H5CH3", and "C6H6") represent simulations by using different seeds (cyclopentadiene, toluene, and benzene respectively). The text files inside each folder are a single trace (time-history) for one SNapS2 simulation. Text file name consists "starting time"+"."+"simulation number"+".txt". For example 0.041.25.txt meaning the 25th simulation starting at 0.041s. Four columns inside the text files represent time, molecular mass, reaction index, and SMILES (Simplified molecular-input line-entry system) of the molecule.

  • Data citation: Wang, Q., Elvati, P., Kim, D., Johansson, K.O., Schrader, P.E., Michelsen, H.A., Violi, A. (2019). Spatial dependence of the growth of polycyclic aromatic compounds in an ethylene counterflow flame: experimental measurements and simulation results [Data set]. University of Michigan Deep Blue Data Repository.  https://doi.org/10.7302/69e6-cd20
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  • bluelion@umich.edu
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Citations to related material
  • Wang, Q., Elvati, P., Kim, D., Johansson, K.O., Schrader, P.E., Michelsen, H.A., Violi, A., 2019. Spatial dependence of the growth of polycyclic aromatic compounds in an ethylene counterflow flame. Carbon 149, 328–335. https://doi.org/10.1016/j.carbon.2019.03.017
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Curation notes
  • Apr. 25, 2019 - Updated Citation to related material field to reflect article publication.
Last modified
  • 08/21/2019
Published
  • 04/01/2019
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To Cite this Work:
Wang, Q., Elvati, P., Kim, D., Johansson, K., Schrader, P., Michelsen, H., Violi, A. (2019). Spatial dependence of the growth of polycyclic aromatic compounds in an ethylene counterflow flame: experimental measurements and simulation results [Data set]. University of Michigan - Deep Blue. https://doi.org/10.7302/69e6-cd20

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